N-(5-cyclopentyl-2-phenyl-pyrazol-3-yl)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(5-cyclopentyl-2-phenyl-pyrazol-3-yl)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(5-cyclopentyl-2-phenyl-pyrazol-3-yl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-(5-cyclopentyl-2-phenyl-3-pyrazolyl)-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(5-cyclopentyl-2-phenylpyrazol-3-yl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-(5-cyclopentyl-2-phenyl-pyrazol-3-yl)-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C20H26N5O2+ MolecularWeight: 368.45274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NN(C(=C2)NC(=O)C[NH+]3CCNC(=O)C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)C2=NN(C(=C2)NC(=O)C[NH+]3CCNC(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C20H25N5O2/c26-19-13-24(11-10-21-19)14-20(27)22-18-12-17(15-6-4-5-7-15)23-25(18)16-8-2-1-3-9-16/h1-3,8-9,12,15H,4-7,10-11,13-14H2,(H,21,26)(H,22,27)/p+1